- InChI
- InChI=1S/C14H26O4/c1-9(2)8-17-12(15)7-13(16)18-14(10(3)4)11(5)6/h9-11,14H,7-8H2,1-6H3
- InChI Key
- BANWDECBRTURCN-UHFFFAOYSA-N
- Formula
- C14H26O4
- SMILES
-
CC(C)COC(=O)CC(=O)OC(C(C)C)C(C
)C - Molecular Weight1
- 258.35
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfG° | -410.60 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -843.01 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 23.50 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 63.52 | kJ/mol | Joback Calculated Property |
| log10WS | -2.79 | Crippen Calculated Property | |
| logPoct/wat | 2.800 | Crippen Calculated Property | |
| McVol | 223.000 | ml/mol | McGowan Calculated Property |
| Pc | 1682.41 | kPa | Joback Calculated Property |
| Inp | [1536.00; 1536.00] |
|
|
| Inp | 1536.00 | NIST | |
| Inp | 1536.00 | NIST | |
| Tboil | 670.54 | K | Joback Calculated Property |
| Tc | 856.79 | K | Joback Calculated Property |
| Tfus | 331.86 | K | Joback Calculated Property |
| Vc | 0.844 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [624.02; 711.58] | J/mol×K | [670.54; 856.79] |
|
| Cp,gas | 624.02 | J/mol×K | 670.54 | Joback Calculated Property |
| Cp,gas | 640.70 | J/mol×K | 701.58 | Joback Calculated Property |
| Cp,gas | 656.54 | J/mol×K | 732.62 | Joback Calculated Property |
| Cp,gas | 671.54 | J/mol×K | 763.67 | Joback Calculated Property |
| Cp,gas | 685.72 | J/mol×K | 794.71 | Joback Calculated Property |
| Cp,gas | 699.06 | J/mol×K | 825.75 | Joback Calculated Property |
| Cp,gas | 711.58 | J/mol×K | 856.79 | Joback Calculated Property |
| η | [0.0000887; 0.0040844] | Pa×s | [331.86; 670.54] |
|
| η | 0.0040844 | Pa×s | 331.86 | Joback Calculated Property |
| η | 0.0013564 | Pa×s | 388.31 | Joback Calculated Property |
| η | 0.0005959 | Pa×s | 444.75 | Joback Calculated Property |
| η | 0.0003151 | Pa×s | 501.20 | Joback Calculated Property |
| η | 0.0001895 | Pa×s | 557.65 | Joback Calculated Property |
| η | 0.0001252 | Pa×s | 614.09 | Joback Calculated Property |
| η | 0.0000887 | Pa×s | 670.54 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Malonic acid, 2,4-dimethylpent-3-yl isobutyl ester.
Sources
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